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493783

Sigma-Aldrich

4-Cyanophenyl isocyanate

97%

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About This Item

Linear Formula:
NCC6H4NCO
CAS Number:
40465-45-0
Molecular Weight:
144.13
EC Number:
254-934-0
MDL number:
MFCD00037038
UNSPSC Code:
12352100
PubChem Substance ID:
24872859
NACRES:
NA.22

Quality Level

100

Assay

97%

mp

101-104 °C (lit.)

storage temp.

2-8°C

SMILES string

O=C=Nc1ccc(cc1)C#N

InChI

1S/C8H4N2O/c9-5-7-1-3-8(4-2-7)10-6-11/h1-4H

InChI key

TVSXDZNUTPLDKY-UHFFFAOYSA-N

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General description

4-Cyanophenyl isocyanate, also known as 4-isocyanatobenzonitrile, is an aryl isocyanate. It alters the surface of silk sericin in lithium chloride/dimethyl sulfoxide solvent by forming urethane linkages.

Pictograms

Health hazardExclamation mark
GHS08,GHS07

Signal Word

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

PDSCL

Deleterious substance

JAN Code

493783-BULK:
493783-10G:4548173162287
493783-VAR:
493783-2G:4548173162294

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Linrong Zhu et al.
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Hidetoshi Teramoto et al.
Biomacromolecules, 5(4), 1392-1398 (2004-07-13)
This paper reports chemical modification of silk sericin in LiCl/dimethyl sulfoxide (DMSO) solvent with 4-cyanophenyl isocyanate. Sericin is a highly hydrophilic protein secreted by Bombyx mori, serving as a protein glue in a cocoon. LiCl/DMSO was found to be a
Design, synthesis and antiproliferative activities of diaryl urea derivatives bearing N-acylhydrazone moiety.
Zhang B, et al.
Chinese Chemical Letters = Zhongguo Hua Xue Kuai Bao, 23(8), 915-918 (2012)
Reactivity of Hydroxy and Amino Derivatives of 2-Phenyl-1H-imidazoline and 2-Phenyl-1H-imidazole toward Isocyanates: Synthesis of Appropriate Carbamates and Ureas.
Parik P, et al.
Journal of Heterocyclic Chemistry, 50(4), 903-910 (2013)
Xue-Feng Cheng et al.
Chemistry, an Asian journal, 12(1), 45-51 (2016-10-27)
Herein, two molecules based on urea and thiourea, which differ by only a single atom, were designed, successfully synthesized, and fabricated into resistive random-access memory devices (RRAM). The urea-based molecule showed binary write-once-read-many (WORM) storage behavior, whereas the thiourea-based molecule

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